Compound Synopsis
Compound Overview
Bioactivity Data Summary
Protein Affinity Profile
Cellline Sensitivity Profile

1850752 - Overview - Compound Synopsis

Synonyms
5GN
Molecular Formula
C22H19BrN4OS2
InChI
InChI=1S/C22H19BrN4OS2/c1-13-8-14(2)26-22(25-13)29-12-20(28)27-21-24-11-18(30-21)9-16-5-3-4-15-6-7-17(23)10-19(15)16/h3-8,10-11H,9,12H2,1-2H3,(H,24,27,28)
Smiles
Cc1cc(C)nc(SCC(=O)Nc2ncc(Cc3cccc4ccc(Br)cc34)s2)n1
Cross References
UniChem110999144
canSAR1850752
PDBe (Protein Data Bank Europe)5GN
ChEMBLCHEMBL3771286
BindingDB50148789
Commercially Available
Unknown


MOLECULAR_WEIGHT ALOGP HBOND_DONORS HBOND_ACCEPTORS ATOMS CONTAINS_TOXICOPHORE
Properties 498.0183653285.787241549No


Compounds with the same scaffold


Image of compound ID: 1850752
Murko Scaffold Family: 20 compoundsClick here to open a new canSAR search with these compounds

Maximum number shown here is 12